Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | APP | P05067 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.52 |
| ▸ | KDM6A | O15550 | 1/20 | 0.47 |
| ▸ | KDM4A | O75164 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KDM5C | P41229 | 1/20 | 0.47 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.47 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.47 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.44 |
| ▸ | MAOB | P27338 | 6/20 | 0.43 |
| ▸ | COMT | P21964 | 1/20 | 0.42 |
| ▸ | FABP4 | P15090 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16625510 | 1.00 | KDM4E (0.52) | KDM4ETP53CYP2D6HTTSMN1; SMN2 | |
| SCHEMBL16625508 | 1.00 | KDM4E (0.52) | KDM4ETP53CYP2D6HTTSMN1; SMN2 | |
| SCHEMBL9700234 | 0.94 | KDM4E (0.55) | KDM4ETP53CYP2D6HTTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9699087 | 0.93 | KDM4E (0.54) | KDM4ETP53CYP2D6HTTSMN1; SMN2 | |
| SCHEMBL9513592 | 0.89 | APP (0.61) | KDM4ETP53CYP2D6HTTSMN1; SMN2 | |
| SCHEMBL10359200 | 0.89 | APP (0.61) | KDM4ETP53CYP2D6HTTSMN1; SMN2 | |
| SCHEMBL3686713 | 0.88 | KDM4E (0.58) | KDM4ETP53CYP2D6HTTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8092834 | 0.86 | KDM4E (0.56) | KDM4ETP53CYP2D6HTTSMN1; SMN2 | |
| SCHEMBL9513624 | 0.83 | APP (0.48) | KDM4ETP53CYP2D6HTTSMN1; SMN2 | |
| SCHEMBL10926016 | 0.83 | APP (0.56) | KDM4ETP53CYP2D6HTTSMN1; SMN2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180338897-A1 | ORAL COMPOSITIONS FOR REDUCING DENTAL STAINS | NEW YORK UNIVERSITY | 2018-11-29 | — | — | US | disclosed |
| US-20150096755-A1 | COMPOSITIONS COMPRISING CARBON DIOXIDE AND REVERSE MICELLES AND METHODS OF USE | NEW YORK UNIVERSITY (US) | 2015-04-09 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20180338897-A1 | ORAL COMPOSITIONS FOR REDUCING DENTAL STAINS | G6PD, SDHB, SDHA | KDM4E 3168/4885TP53 1683/4885CYP2D6 717/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.